1-[(2,4-dichlorophenyl)methyl]pyridin-1-ium-3-carboxamide chloride

Systemtic Name: 1-[(2,4-dichlorophenyl)methyl]pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-[(2,4-dichlorophenyl)methyl]pyridin-1-ium-3-carboxamide chloride CAS Name: 1-[(2,4-dichlorophenyl)methyl]-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[(2,4-dichlorophenyl)methyl]pyridin-1-ium-3-carboxamide chloride Traditional Name: 1-(2,4-dichlorobenzyl)pyridin-1-ium-3-carboxamide chloride Formula: C13H11Cl3N2O MolecularWeight: 317.59824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC2=C(C=C(C=C2)Cl)Cl)C(=O)N.[Cl-]

Isomeric SMILES

C1=CC(=C[N+](=C1)CC2=C(C=C(C=C2)Cl)Cl)C(=O)N.[Cl-]

InChI

InChI=1S/C13H10Cl2N2O.ClH/c14-11-4-3-9(12(15)6-11)7-17-5-1-2-10(8-17)13(16)18;/h1-6,8H,7H2,(H-,16,18);1H